2-methoxy-N-[4-methylsulfanyl-1-oxidanylidene-1-(2-quinolin-2-ylethylamino)butan-2-yl]benzamide

Systemtic Name: 2-methoxy-N-[4-methylsulfanyl-1-oxidanylidene-1-(2-quinolin-2-ylethylamino)butan-2-yl]benzamide Openeye Name: 2-methoxy-N-[3-methylsulfanyl-1-[2-(2-quinolyl)ethylcarbamoyl]propyl]benzamide CAS Name: 2-methoxy-N-[4-(methylthio)-1-oxo-1-[2-(2-quinolinyl)ethylamino]butan-2-yl]benzamide IUPAC Name: 2-methoxy-N-[4-methylsulfanyl-1-oxo-1-(2-quinolin-2-ylethylamino)butan-2-yl]benzamide Traditional Name: 2-methoxy-N-[3-(methylthio)-1-[2-(2-quinolyl)ethylcarbamoyl]propyl]benzamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCCC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCCC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C24H27N3O3S/c1-30-22-10-6-4-8-19(22)23(28)27-21(14-16-31-2)24(29)25-15-13-18-12-11-17-7-3-5-9-20(17)26-18/h3-12,21H,13-16H2,1-2H3,(H,25,29)(H,27,28)